1,5,7-三氮杂双环［4.4.0］癸-5-烯
TL;DR: 1,5,7-三氮杂双环［4.4.0］癸-5-烯 (CAS 5807-14-7) is a chemical compound with molecular formula C7H13N3 and molecular weight 139.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5,7-三氮杂双环［4.4.0］癸-5-烯
3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine
Also Known As: 1,5,7-Triazabicyclo[4.4.0]dec-5-ene, Triazabicyclodecene, Hhpp, 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]pyrimidine, TBD compound
| Molecular Formula | C7H13N3 |
|---|---|
| Molecular Weight | 139.11 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 27.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 139.11095 |
| Heavy Atoms | 10 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 5807-14-7 |
|---|---|
| SMILES | C1CNC2=NCCCN2C1 |
| InChIKey | FVKFHMNJTHKMRX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5,7-三氮杂双环［4.4.0］癸-5-烯 (CAS 5807-14-7), with molecular formula C7H13N3 and molecular weight 139.11 g/mol. IUPAC: 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine.
Chemical Property Profile of 1,5,7-三氮杂双环［4.4.0］癸-5-烯
Property Insights of 1,5,7-三氮杂双环［4.4.0］癸-5-烯
The XLogP value of -0.3 indicates that 1,5,7-三氮杂双环［4.4.0］癸-5-烯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.6 Ų, 1,5,7-三氮杂双环［4.4.0］癸-5-烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5,7-三氮杂双环［4.4.0］癸-5-烯 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,5,7-三氮杂双环［4.4.0］癸-5-烯?
The CAS number of 1,5,7-三氮杂双环［4.4.0］癸-5-烯 is 5807-14-7.
What is the molecular formula of 1,5,7-三氮杂双环［4.4.0］癸-5-烯?
The molecular formula of 1,5,7-三氮杂双环［4.4.0］癸-5-烯 is C7H13N3.
What is the molecular weight of 1,5,7-三氮杂双环［4.4.0］癸-5-烯?
The molecular weight of 1,5,7-三氮杂双环［4.4.0］癸-5-烯 is 139.11 g/mol.
Where can I buy 1,5,7-三氮杂双环［4.4.0］癸-5-烯?
You can request a quote for 1,5,7-三氮杂双环［4.4.0］癸-5-烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5,7-三氮杂双环［4.4.0］癸-5-烯?
Yes, KEHONG BIO provides custom synthesis services for 1,5,7-三氮杂双环［4.4.0］癸-5-烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.